#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j9i s GLU 2 N 0.00 2.13 0.33 2.12 2.12 -1.25 0.25 118.70 124.40 1j9i s GLU 2 Ca 0.00 -2.15 0.06 0.00 0.36 0.00 0.00 54.97 53.23 1j9i s GLU 2 Cb 0.00 -3.56 -0.01 0.00 0.26 0.00 0.00 34.13 30.81 1j9i s GLU 2 CO 0.00 -1.10 0.47 0.14 -0.54 0.00 0.00 175.26 174.24 1j9i s VAL 3 N 0.56 4.29 0.63 3.70 -7.23 -0.46 -4.77 120.40 117.12 1j9i s VAL 3 Ca 0.12 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.37 1j9i s VAL 3 Cb -0.22 -3.50 0.08 0.00 0.56 0.00 0.00 36.38 33.30 1j9i s VAL 3 CO -0.04 -0.21 0.87 0.20 -0.31 0.00 0.00 175.10 175.61 1j9i s ASN 4 N -4.14 4.85 0.42 4.85 0.01 -1.26 -0.96 114.94 118.71 1j9i s ASN 4 Ca 0.43 -0.27 0.26 0.00 -0.71 0.00 0.00 52.86 52.57 1j9i s ASN 4 Cb -0.09 -0.36 1.31 0.00 0.41 0.00 0.00 41.25 42.52 1j9i s ASN 4 CO 0.31 -1.48 1.68 0.11 -1.51 0.00 0.00 177.10 176.21 1j9i h LYS 5 N -0.17 0.19 0.00 -0.60 1.79 -1.82 0.87 116.57 116.83 1j9i h LYS 5 Ca -0.38 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.08 1j9i h LYS 5 Cb 1.28 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1j9i h LYS 5 CO 0.45 0.12 -0.02 -0.22 -1.08 0.00 0.00 179.45 178.71 1j9i h LYS 6 N 0.19 0.00 -0.97 3.15 1.63 -1.97 -3.14 116.57 115.46 1j9i h LYS 6 Ca 0.74 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 60.71 1j9i h LYS 6 Cb 2.18 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 33.72 1j9i h LYS 6 CO -0.38 0.14 0.61 1.96 -3.45 0.00 0.00 179.45 178.33 1j9i h GLN 7 N -1.00 0.69 -0.13 1.90 1.08 -1.71 -0.42 115.11 115.53 1j9i h GLN 7 Ca -0.00 -0.04 0.05 0.00 -1.45 0.00 0.00 58.65 57.20 1j9i h GLN 7 Cb 0.16 -0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 27.37 1j9i h GLN 7 CO -0.00 0.46 -0.34 1.25 -0.95 0.00 0.00 178.83 179.25 1j9i h LEU 8 N 0.72 -1.04 -1.18 1.46 6.46 0.66 1.12 115.31 123.50 1j9i h LEU 8 Ca 0.53 0.15 -0.06 0.00 -0.12 0.00 0.00 57.88 58.37 1j9i h LEU 8 Cb 0.88 0.44 -0.01 0.00 -0.73 0.00 0.00 40.66 41.23 1j9i h LEU 8 CO -0.29 -0.37 -0.12 0.00 -0.62 0.00 0.00 178.44 177.03 1j9i h ALA 9 N 0.38 1.32 -0.64 1.25 0.00 -1.16 -2.11 119.26 118.30 1j9i h ALA 9 Ca 0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1j9i h ALA 9 Cb 0.56 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1j9i h ALA 9 CO -0.36 0.46 0.31 -0.44 0.00 0.00 0.00 179.25 179.21 1j9i h ASP 10 N 0.39 0.83 0.15 0.00 3.32 0.74 0.40 116.42 122.26 1j9i h ASP 10 Ca 0.08 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.00 1j9i h ASP 10 Cb 0.45 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.75 1j9i h ASP 10 CO 0.03 0.73 -0.52 0.40 -1.72 0.00 0.00 179.24 178.15 1j9i h ILE 11 N 0.88 0.00 0.00 0.35 1.08 0.19 0.19 117.51 120.19 1j9i h ILE 11 Ca 0.22 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.69 1j9i h ILE 11 Cb 0.12 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.87 1j9i h ILE 11 CO -0.03 0.00 0.00 0.49 -0.69 0.00 0.00 178.15 177.92 1j9i n PHE 12 N -5.42 0.00 -1.88 1.37 3.01 -1.11 -4.79 117.46 108.63 1j9i n PHE 12 Ca -0.09 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.27 1j9i n PHE 12 Cb 0.41 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.86 1j9i n PHE 12 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j9i n GLY 13 N 0.54 0.22 0.00 1.37 0.00 0.84 -4.87 105.19 103.29 1j9i n GLY 13 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1j9i n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9i n ALA 14 N -1.08 0.00 -2.82 4.61 0.00 0.11 -4.96 120.51 116.36 1j9i n ALA 14 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 1j9i n ALA 14 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 1j9i n ALA 14 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j9i s SER 15 N -1.00 5.59 0.55 0.00 1.04 -1.26 -4.61 113.70 114.00 1j9i s SER 15 Ca 0.00 0.09 0.34 0.00 0.48 0.00 0.00 55.95 56.86 1j9i s SER 15 Cb 0.00 -1.93 1.50 0.00 0.10 0.00 0.00 66.02 65.69 1j9i s SER 15 CO 0.00 0.20 1.82 0.40 0.98 0.00 0.00 173.24 176.63 1j9i h ILE 16 N 4.80 0.42 -1.00 -1.02 2.04 -1.89 2.45 117.51 123.31 1j9i h ILE 16 Ca -0.38 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.59 1j9i h ILE 16 Cb 1.17 0.46 -0.08 0.00 -0.74 0.00 0.00 36.82 37.63 1j9i h ILE 16 CO 0.69 0.00 0.63 0.03 0.00 0.00 0.00 178.15 179.50 1j9i h ARG 17 N 0.00 1.00 -0.19 2.37 2.47 -1.96 2.33 114.38 120.39 1j9i h ARG 17 Ca 0.47 -0.06 -0.10 0.00 -1.26 0.00 0.00 59.98 59.03 1j9i h ARG 17 Cb 2.00 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 30.08 1j9i h ARG 17 CO -0.00 0.66 -0.31 1.15 0.56 0.00 0.00 179.97 182.02 1j9i h THR 18 N 1.03 1.28 -0.21 2.04 2.02 0.38 0.55 112.91 119.99 1j9i h THR 18 Ca 0.48 -1.35 -0.17 0.00 0.77 0.00 0.00 66.41 66.14 1j9i h THR 18 Cb 0.42 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1j9i h THR 18 CO -0.24 0.42 -0.52 0.40 0.37 0.00 0.00 175.52 175.95 1j9i h ILE 19 N 0.33 1.30 0.00 3.11 1.08 0.14 0.56 117.51 124.04 1j9i h ILE 19 Ca 0.04 -1.74 0.00 0.00 -0.39 0.00 0.00 64.86 62.78 1j9i h ILE 19 Cb 0.72 1.84 0.00 0.00 -3.07 0.00 0.00 36.82 36.31 1j9i h ILE 19 CO 0.06 0.55 0.00 1.56 -0.69 0.00 0.00 178.15 179.62 1j9i h GLN 20 N 0.45 0.00 0.11 2.37 4.20 0.40 0.43 115.11 123.06 1j9i h GLN 20 Ca -0.00 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.36 1j9i h GLN 20 Cb 1.14 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 1j9i h GLN 20 CO 0.11 0.00 -1.89 0.09 -0.67 0.00 0.00 178.83 176.47 1j9i n ASN 21 N -2.76 2.09 -0.07 1.46 4.13 0.14 -3.81 115.26 116.43 1j9i n ASN 21 Ca -0.01 0.24 -0.10 0.00 1.68 0.00 0.00 54.58 56.39 1j9i n ASN 21 Cb 0.14 -0.88 -0.03 0.00 -1.54 0.00 0.00 39.78 37.46 1j9i n ASN 21 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1j9i h TRP 22 N -0.10 0.35 0.00 3.10 4.06 0.11 0.22 115.95 123.68 1j9i h TRP 22 Ca -0.42 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.52 1j9i h TRP 22 Cb 1.92 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 29.97 1j9i h TRP 22 CO 0.08 0.32 0.00 -0.56 -3.56 0.00 0.00 178.44 174.72 1j9i h GLN 23 N 0.27 0.00 -0.01 0.49 -0.00 -1.13 -1.17 115.11 113.57 1j9i h GLN 23 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.74 1j9i h GLN 23 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.57 1j9i h GLN 23 CO -0.01 0.00 -0.25 0.39 -0.00 0.00 0.00 178.83 178.96 1j9i n GLU 24 N -2.96 2.23 0.04 0.06 -0.58 -0.75 -4.47 120.64 114.20 1j9i n GLU 24 Ca -0.03 -0.55 0.01 0.00 -0.42 0.00 0.00 57.16 56.17 1j9i n GLU 24 Cb 0.07 -1.09 -0.07 0.00 -0.57 0.00 0.00 31.44 29.78 1j9i n GLU 24 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 1j9i h GLN 25 N 1.04 0.00 0.00 3.49 7.50 0.58 -3.47 115.11 124.25 1j9i h GLN 25 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1j9i h GLN 25 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.88 1j9i h GLN 25 CO 0.00 0.27 0.00 0.41 -1.50 0.00 0.00 178.83 178.01 1j9i n GLY 26 N 1.37 0.56 3.76 3.46 0.00 -1.04 -4.98 105.19 108.33 1j9i n GLY 26 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1j9i n GLY 26 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1j9i s MET 27 N 0.00 4.67 -0.74 1.61 0.00 -0.70 -4.90 119.30 119.25 1j9i s MET 27 Ca 0.00 1.58 -0.23 0.00 0.00 0.00 0.00 55.69 57.04 1j9i s MET 27 Cb 0.00 -3.10 -0.17 0.00 0.00 0.00 0.00 34.83 31.55 1j9i s MET 27 CO 0.00 0.31 1.89 -0.35 0.00 0.00 0.00 175.02 176.87 1j9i n PRO 28 N 1.08 1.35 -2.58 4.11 -0.04 -1.26 -4.86 135.00 132.80 1j9i n PRO 28 Ca -0.00 -1.82 -0.35 0.00 -0.04 0.00 0.00 63.50 61.29 1j9i n PRO 28 Cb 0.47 -2.97 -0.04 0.00 -0.04 0.00 0.00 33.50 30.92 1j9i n PRO 28 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1j9i s VAL 29 N 5.93 3.84 0.00 0.52 0.11 -1.26 -3.48 120.40 126.06 1j9i s VAL 29 Ca 0.60 1.22 0.00 0.00 -2.93 0.00 0.00 61.98 60.87 1j9i s VAL 29 Cb 0.13 -3.53 0.00 0.00 -1.53 0.00 0.00 36.38 31.45 1j9i s VAL 29 CO 0.14 -0.18 0.86 0.18 -3.33 0.00 0.00 175.10 172.77 1j9i n LEU 30 N -0.68 0.00 0.00 2.54 4.32 0.94 -4.80 117.00 119.32 1j9i n LEU 30 Ca 0.08 0.86 -0.16 0.00 -0.02 0.00 0.00 56.01 56.77 1j9i n LEU 30 Cb 0.52 -0.36 0.08 0.00 -1.62 0.00 0.00 43.42 42.05 1j9i n LEU 30 CO 0.41 -0.36 0.39 0.54 -1.22 0.00 0.00 177.39 177.15 1j9i n ARG 31 N -1.65 0.01 0.00 3.23 3.00 -1.26 -4.83 116.66 115.16 1j9i n ARG 31 Ca 0.00 -1.71 0.11 0.00 -0.01 0.00 0.00 57.85 56.24 1j9i n ARG 31 Cb 0.00 -0.49 0.10 0.00 0.00 0.00 0.00 32.46 32.07 1j9i n ARG 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1j9i n GLY 32 N -0.07 -1.15 4.34 -0.13 0.00 -1.26 -4.41 105.19 102.51 1j9i n GLY 32 Ca 0.11 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1j9i n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9i n GLY 33 N 1.50 -0.29 2.56 -0.02 0.00 -1.26 -4.65 105.19 103.02 1j9i n GLY 33 Ca 0.05 0.13 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1j9i n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9i n GLY 34 N -1.74 2.68 5.00 -0.02 0.00 -1.26 -4.57 105.19 105.27 1j9i n GLY 34 Ca -0.09 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1j9i n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j9i n LYS 35 N 3.90 0.00 -0.16 1.61 4.81 -1.26 -4.19 118.16 122.87 1j9i n LYS 35 Ca 0.34 0.00 0.19 0.00 -0.87 0.00 0.00 58.31 57.97 1j9i n LYS 35 Cb 0.20 0.00 0.57 0.00 0.02 0.00 0.00 35.03 35.82 1j9i n LYS 35 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1j9i h GLY 36 N 0.00 0.54 0.00 3.14 0.00 -1.99 -3.41 103.07 101.35 1j9i h GLY 36 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1j9i h GLY 36 CO 0.00 0.02 0.00 0.70 0.00 0.00 0.00 176.54 177.26 1j9i n ASN 37 N -4.44 0.00 -0.43 0.19 3.02 -1.26 -5.06 115.26 107.28 1j9i n ASN 37 Ca 0.16 -0.11 0.01 0.00 -0.03 0.00 0.00 54.58 54.61 1j9i n ASN 37 Cb 0.65 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.84 1j9i n ASN 37 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1j9i n GLU 38 N -0.11 0.16 -2.23 3.52 0.28 -1.26 -4.65 120.64 116.35 1j9i n GLU 38 Ca 0.00 -1.17 0.00 0.00 -0.16 0.00 0.00 57.16 55.83 1j9i n GLU 38 Cb 0.00 -0.62 0.00 0.00 1.43 0.00 0.00 31.44 32.25 1j9i n GLU 38 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1j9i n VAL 39 N -0.17 -0.48 -1.86 3.84 0.31 -1.26 -4.62 118.33 114.08 1j9i n VAL 39 Ca 0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.27 1j9i n VAL 39 Cb 0.69 -1.77 0.05 0.00 -0.91 0.00 0.00 33.84 31.90 1j9i n VAL 39 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1j9i n LEU 40 N 2.15 0.00 -3.75 7.52 7.99 -1.26 -4.35 117.00 125.30 1j9i n LEU 40 Ca 0.00 -0.53 -0.13 0.00 -0.01 0.00 0.00 56.01 55.34 1j9i n LEU 40 Cb 0.00 -0.24 -0.14 0.00 -0.11 0.00 0.00 43.42 42.94 1j9i n LEU 40 CO 0.00 -0.70 -0.19 -0.31 -1.51 0.00 0.00 177.39 174.68 1j9i s TYR 41 N -1.23 -0.22 -1.12 -1.77 2.02 -0.14 -0.04 117.35 114.86 1j9i s TYR 41 Ca 0.20 0.58 -0.21 0.00 -0.37 0.00 0.00 57.07 57.27 1j9i s TYR 41 Cb -0.01 -0.03 0.04 0.00 -0.40 0.00 0.00 41.96 41.57 1j9i s TYR 41 CO 0.14 -0.18 1.61 -0.51 -1.57 0.00 0.00 175.55 175.04 1j9i s ASP 42 N 1.11 6.45 0.29 2.29 1.01 -1.23 -1.36 116.67 125.23 1j9i s ASP 42 Ca -0.08 -1.75 0.23 0.00 0.71 0.00 0.00 52.55 51.65 1j9i s ASP 42 Cb -0.10 -2.57 0.97 0.00 1.01 0.00 0.00 42.92 42.23 1j9i s ASP 42 CO -0.06 -1.56 0.98 -0.24 0.21 0.00 0.00 175.17 174.50 1j9i n SER 43 N 9.36 0.10 0.10 0.27 2.88 0.71 0.32 113.62 127.36 1j9i n SER 43 Ca 0.40 0.81 -0.20 0.00 -1.33 0.00 0.00 58.87 58.55 1j9i n SER 43 Cb 0.49 -0.40 -0.15 0.00 -0.75 0.00 0.00 64.21 63.40 1j9i n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j9i h ALA 44 N 0.91 0.09 0.00 -1.46 0.00 -1.87 -3.12 119.26 113.81 1j9i h ALA 44 Ca 0.56 -1.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 1j9i h ALA 44 Cb 1.92 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.93 1j9i h ALA 44 CO -0.23 0.96 -0.49 0.00 0.00 0.00 0.00 179.25 179.49 1j9i h ALA 45 N 0.33 0.85 0.00 0.00 0.00 0.47 -2.66 119.26 118.26 1j9i h ALA 45 Ca -0.25 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1j9i h ALA 45 Cb 2.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1j9i h ALA 45 CO 0.21 0.62 0.00 0.28 0.00 0.00 0.00 179.25 180.35 1j9i n VAL 46 N -3.47 0.79 -0.08 0.00 0.31 0.40 -3.16 118.33 113.11 1j9i n VAL 46 Ca 0.00 0.15 -0.08 0.00 -0.01 0.00 0.00 64.34 64.40 1j9i n VAL 46 Cb 0.62 -1.03 -0.03 0.00 -0.91 0.00 0.00 33.84 32.49 1j9i n VAL 46 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1j9i n ILE 47 N -2.12 1.42 -0.31 2.52 -5.35 -1.02 -3.10 119.36 111.39 1j9i n ILE 47 Ca 0.03 0.16 0.35 0.00 -0.27 0.00 0.00 62.75 63.02 1j9i n ILE 47 Cb 0.26 -2.29 0.66 0.00 -1.74 0.00 0.00 39.64 36.53 1j9i n ILE 47 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1j9i h LYS 48 N -0.92 0.00 0.00 6.28 3.64 -1.64 2.31 116.57 126.24 1j9i h LYS 48 Ca 0.00 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.11 1j9i h LYS 48 Cb 0.92 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.70 1j9i h LYS 48 CO 0.00 0.00 -1.56 2.35 -2.27 0.00 0.00 179.45 177.97 1j9i h TRP 49 N 0.00 0.00 0.10 1.91 7.01 -1.74 -3.17 115.95 120.06 1j9i h TRP 49 Ca 0.57 -0.00 -0.36 0.00 2.11 0.00 0.00 58.89 61.21 1j9i h TRP 49 Cb 2.68 -0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 29.72 1j9i h TRP 49 CO 0.00 1.00 -2.05 0.98 -2.79 0.00 0.00 178.44 175.59 1j9i n TYR 50 N -3.11 1.05 0.21 2.65 9.36 0.68 -4.29 117.16 123.71 1j9i n TYR 50 Ca -0.13 0.23 0.11 0.00 3.32 0.00 0.00 57.90 61.43 1j9i n TYR 50 Cb 1.03 -1.13 0.17 0.00 -0.63 0.00 0.00 39.34 38.77 1j9i n TYR 50 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1j9i h ALA 51 N 0.03 0.97 0.00 2.98 0.00 0.14 0.48 119.26 123.85 1j9i h ALA 51 Ca -0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1j9i h ALA 51 Cb 1.98 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1j9i h ALA 51 CO 0.04 0.06 0.00 0.39 0.00 0.00 0.00 179.25 179.74 1j9i n GLU 52 N -3.11 0.67 0.00 0.00 1.02 -1.20 -3.98 120.64 114.03 1j9i n GLU 52 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1j9i n GLU 52 Cb 0.54 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1j9i n GLU 52 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1j9i n ARG 53 N -0.73 0.38 0.00 3.49 1.85 -1.22 -5.00 116.66 115.43 1j9i n ARG 53 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.92 1j9i n ARG 53 Cb 0.03 -0.10 0.00 0.00 -1.05 0.00 0.00 32.46 31.35 1j9i n ARG 53 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1j9i n ASP 54 N -0.33 0.92 -4.24 2.89 8.00 -0.84 -4.89 116.55 118.05 1j9i n ASP 54 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 1j9i n ASP 54 Cb 0.00 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.12 1j9i n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j9i n ALA 55 N -0.98 -1.19 0.00 2.24 0.00 0.16 -3.24 120.51 117.51 1j9i n ALA 55 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1j9i n ALA 55 Cb 0.10 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.04 1j9i n ALA 55 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1j9i n GLU 56 N -3.95 0.00 0.00 0.00 -0.58 -1.26 -4.95 120.64 109.90 1j9i n GLU 56 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1j9i n GLU 56 Cb 0.46 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.33 1j9i n GLU 56 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1j9i n ILE 57 N 0.00 0.00 -1.46 -3.67 -0.00 -1.20 -4.74 119.36 108.29 1j9i n ILE 57 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 62.75 62.59 1j9i n ILE 57 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 39.64 39.57 1j9i n ILE 57 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1j9i n GLU 58 N 0.00 -1.34 0.00 0.38 -0.58 -1.26 -4.56 120.64 113.27 1j9i n GLU 58 Ca 0.00 0.93 0.00 0.00 -0.42 0.00 0.00 57.16 57.67 1j9i n GLU 58 Cb 0.00 -5.22 0.00 0.00 -0.57 0.00 0.00 31.44 25.65 1j9i n GLU 58 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1j9i n ASN 59 N -0.79 1.06 -0.04 1.62 5.15 -1.26 -4.31 115.26 116.68 1j9i n ASN 59 Ca -0.16 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 53.79 1j9i n ASN 59 Cb 0.52 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.69 1j9i n ASN 59 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1j9i n GLU 60 N -2.00 2.05 -0.02 1.20 0.28 -1.26 -4.28 120.64 116.61 1j9i n GLU 60 Ca 0.00 -0.02 0.03 0.00 -0.16 0.00 0.00 57.16 57.01 1j9i n GLU 60 Cb 0.17 -1.26 -0.13 0.00 1.43 0.00 0.00 31.44 31.64 1j9i n GLU 60 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1j9i n LYS 61 N -2.30 0.66 0.00 3.44 4.81 -1.26 -4.00 118.16 119.51 1j9i n LYS 61 Ca -0.14 -0.04 0.14 0.00 -0.87 0.00 0.00 58.31 57.40 1j9i n LYS 61 Cb 0.74 -1.60 0.59 0.00 0.02 0.00 0.00 35.03 34.78 1j9i n LYS 61 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1j9i n LEU 62 N -2.55 0.31 0.00 3.14 7.94 -1.26 -3.57 117.00 121.01 1j9i n LEU 62 Ca -0.12 0.15 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 1j9i n LEU 62 Cb 0.78 -0.27 0.00 0.00 0.53 0.00 0.00 43.42 44.45 1j9i n LEU 62 CO 0.44 0.06 0.11 0.54 -1.11 0.00 0.00 177.39 177.43 1j9i n ARG 63 N -1.19 0.00 -0.06 1.96 1.74 -1.26 -4.15 116.66 113.71 1j9i n ARG 63 Ca 0.12 0.14 -0.02 0.00 -0.77 0.00 0.00 57.85 57.31 1j9i n ARG 63 Cb 0.29 -0.72 -0.13 0.00 -1.02 0.00 0.00 32.46 30.88 1j9i n ARG 63 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1j9i n ARG 64 N -0.35 1.01 -0.81 5.56 3.00 -1.26 -4.51 116.66 119.30 1j9i n ARG 64 Ca 0.00 -0.06 -0.08 0.00 -0.00 0.00 0.00 57.85 57.71 1j9i n ARG 64 Cb 0.00 -1.43 -0.11 0.00 0.00 0.00 0.00 32.46 30.92 1j9i n ARG 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1j9i n GLU 65 N -2.44 1.61 0.00 -0.14 1.02 -1.23 -4.62 120.64 114.84 1j9i n GLU 65 Ca -0.19 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.29 1j9i n GLU 65 Cb 0.84 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1j9i n GLU 65 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1j9i n VAL 66 N 2.23 0.00 -1.62 2.62 0.31 -1.26 -4.66 118.33 115.95 1j9i n VAL 66 Ca 0.29 0.50 0.00 0.00 -0.01 0.00 0.00 64.34 65.12 1j9i n VAL 66 Cb 0.75 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 1j9i n VAL 66 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1j9i n GLU 67 N -0.27 -3.72 0.00 5.55 -0.58 -1.26 -5.04 120.64 115.32 1j9i n GLU 67 Ca 0.00 2.81 0.00 0.00 -0.42 0.00 0.00 57.16 59.55 1j9i n GLU 67 Cb 0.00 -2.95 0.00 0.00 -0.57 0.00 0.00 31.44 27.92 1j9i n GLU 67 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74